809-51-8

Name 7-oxocholest-5-en-3-beta-yl acetate
CAS 809-51-8
EINECS(EC#) 212-368-1
Molecular Formula C29H46O3
Molecular Weight 442.674
MOL File 809-51-8.mol

Chemical Properties

Melting point  157-158 °C
Boiling point  526.9±39.0 °C(Predicted)
density  1.03±0.1 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  Chloroform (Slightly), DMSO (Slightly, Sonicated), Methanol (Slightly, Heated)
form  Solid
color  White to Light Yellow
InChIKey PMBSWZWCNKVWLV-MTSWCIIENA-N
SMILES O=C1C=C2C[C@@H](OC(=O)C)CC[C@]2(C)[C@@]2([H])CC[C@@]3([C@@]([H])([C@H](C)CCCC(C)C)CC[C@@]3([H])[C@]12[H])C |&1:5,12,14,18,19,21,31,33,r|

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